CID 217555

3-(6-cyclopentylhexyl)thiazolidine hydrochloride

Structural Information

Molecular Formula
C14H27NS
SMILES
C1CCC(C1)CCCCCCN2CCSC2
InChI
InChI=1S/C14H27NS/c1(3-7-14-8-4-5-9-14)2-6-10-15-11-12-16-13-15/h14H,1-13H2
InChIKey
VHJMZSVEFNBENR-UHFFFAOYSA-N
Compound name
3-(6-cyclopentylhexyl)-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.18642 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.19370 162.3
[M+Na]+ 264.17564 165.6
[M-H]- 240.17914 166.1
[M+NH4]+ 259.22024 182.3
[M+K]+ 280.14958 162.9
[M+H-H2O]+ 224.18368 155.1
[M+HCOO]- 286.18462 176.3
[M+CH3COO]- 300.20027 190.4
[M+Na-2H]- 262.16109 157.9
[M]+ 241.18587 160.5
[M]- 241.18697 160.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.